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(A) Predicted binding mode of compound 3aa within MAO-B pocket (PDB: 2V5Z) (B) Predicted binding mode of compound 3aa within MAO-A pocket (PDB: 2Z5X): Yellow surface represents the solvent accessible surface of compounds 3aa; (C) Predicted binding mode of compound 3aa within AChE pocket (PDB: 4EY6).
